2-isocyanato-4-methyl-1-propan-2-yl-cyclohexane

Systemtic Name: 2-isocyanato-4-methyl-1-propan-2-yl-cyclohexane Openeye Name: 2-isocyanato-1-isopropyl-4-methyl-cyclohexane CAS Name: 2-isocyanato-4-methyl-1-propan-2-ylcyclohexane IUPAC Name: 2-isocyanato-4-methyl-1-propan-2-ylcyclohexane Traditional Name: 2-isocyanato-1-isopropyl-4-methyl-cyclohexane Formula: C11H19NO MolecularWeight: 181.27466

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)N=C=O)C(C)C

Isomeric SMILES

CC1CCC(C(C1)N=C=O)C(C)C

InChI

InChI=1S/C11H19NO/c1-8(2)10-5-4-9(3)6-11(10)12-7-13/h8-11H,4-6H2,1-3H3